SCHEMBL30883136

SCHEMBL30883136

C=C(C)C(=O)OCCOC(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
THRB P10828 2/20 0.46
CA1 P00915 3/20 0.46
CA2 P00918 3/20 0.46
TSHR P16473 3/20 0.41
ALDH1A1 P00352 2/20 0.33
POLB P06746 1/20 0.33
APEX1 P27695 1/20 0.33
HTT P42858 1/20 0.33
TDP1 Q9NUW8 1/20 0.33

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL26002879 0.98 THRB (0.47) THRBCA1CA2TSHRALDH1A1
SCHEMBL2632775 0.93 THRB (0.49) THRBCA1CA2TSHRALDH1A1
SCHEMBL10219840 0.87 TSHR (0.53) THRBCA1CA2TSHRALDH1A1
SCHEMBL10217004 0.87 TSHR (0.49) THRBCA1CA2TSHRALDH1A1
SCHEMBL2632792 0.86 THRB (0.52) THRBCA1CA2TSHRALDH1A1
SCHEMBL13557333 0.86 THRB (0.55) THRBCA1CA2TSHRALDH1A1
SCHEMBL27964233 0.83 THRB (0.42) THRBCA1CA2TSHRALDH1A1
SCHEMBL27743093 0.83 THRB (0.41) THRBCA1CA2TSHRALDH1A1
SCHEMBL28369516 0.82 TSHR (0.44) THRBCA1CA2TSHRALDH1A1
SCHEMBL25789190 0.81 THRB (0.50) THRBCA1CA2TSHRALDH1A1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117965068-B Preparation method and application of waterproof and anticorrosive paint with high bonding strength 惠州市德泰士达科技有限公司 2024-07-12 CN disclosed
CN-117965068-A Preparation method and application of waterproof and anticorrosive paint with high bonding strength 惠州市德泰士达科技有限公司 2024-05-03 CN disclosed